In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 23rd, 2009 | 22 | Yes |
Popular Name: 1-(2,2-dimethylpropyl)-4-(p-tolylmethylsulfonyl)piperazine 1-(2,2-dimethylpropyl)-4-(p-toly…
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 3.36 | 6.71 | -9.76 | 0 | 4 | 0 | 41 | 324.49 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.36 | 8.24 | -48.91 | 1 | 4 | 1 | 42 | 325.498 | 5 | ↓ |